[(2S)-4-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-2-methyl-butyl]azanium

Systemtic Name: [(2S)-4-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-2-methyl-butyl]azanium Openeye Name: [(2S)-4-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-2-methyl-butyl]ammonium CAS Name: [(2S)-4-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-2-methylbutyl]ammonium IUPAC Name: [(2S)-4-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-2-methylbutyl]azanium Traditional Name: [(2S)-4-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-2-methyl-butyl]ammonium Formula: C14H23N2O2+ MolecularWeight: 251.34462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)(C[NH3+])N(C)C

Isomeric SMILES

C[C@](CCC1=CC2=C(C=C1)OCO2)(C[NH3+])N(C)C

InChI

InChI=1S/C14H22N2O2/c1-14(9-15,16(2)3)7-6-11-4-5-12-13(8-11)18-10-17-12/h4-5,8H,6-7,9-10,15H2,1-3H3/p+1/t14-/m0/s1